SCHEMBL10401121

SCHEMBL10401121

NC1=NNC(=O)/C1=N/OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP8 P40818 2/20 0.39
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39
TUBB2A Q13885 1/20 0.39
TUBB8 Q3ZCM7 1/20 0.39
TUBA3E Q6PEY2 1/20 0.39
TUBA1A Q71U36 1/20 0.39
TUBA1C Q9BQE3 1/20 0.39
TUBB6 Q9BUF5 1/20 0.39
TUBB2B Q9BVA1 1/20 0.39
TUBB1 Q9H4B7 1/20 0.39
KDR P35968 1/20 0.36
LTA4H P09960 1/20 0.36
MAPK14 Q16539 1/20 0.36
RAB9A P51151 3/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10401297 1.00 USP8 (0.39) USP8TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10401475 0.86 L3MBTL1 (0.37) KDRRAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL10401505 0.86 AGXT (0.38) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL10401445 0.81 MAPT (0.44) IDO1MPOPKMGAAMAPT
SCHEMBL10401490 0.80 IDO1 (0.42) RAB9ANPC1ALDH1A1IDO1MAOA
SCHEMBL7611321 0.72 LRRK2 (0.55) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7611320 0.72 LRRK2 (0.55) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL10401448 0.71 TUBB4A (0.40) USP8TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10401447 0.71 TUBB4A (0.40) USP8TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10443114 0.70 NPC1 (0.37) USP8TUBB4ATUBBTUBA3CTUBA1B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2264761-A None JP disclosed
US-4968714-A APPLICATION TO PLANTS, SEEDS, SOILS BAYER AKTIENGESELLSCHAFT (DE) 1990-11-06 US disclosed
JP-H02264761-A SUBSTITUTED 3-AMINO-2-PYRAZOLIN-5-ONE DERIVATIVES, PRODUCTION THEREOF AND USE THEREOF AS PESTICIDE BAYER AG 1990-10-29 JP disclosed